SCHEMBL17540462

SCHEMBL17540462

O=C(O/N=C(\CCC1CCCCC1)C(=O)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.53
ALDH1A1 P00352 7/20 0.52
KMT2A Q03164 3/20 0.52
MEN1 O00255 2/20 0.52
SMN1; SMN2 Q16637 3/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
NPC1 O15118 1/20 0.42
PKM P14618 1/20 0.42
RAB9A P51151 1/20 0.42
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
CRHBP P24387 1/20 0.39
CRHR2 Q13324 1/20 0.39
ALOX5 P09917 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL17540444 0.91 L3MBTL1 (0.43) MAPTALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL17070003 0.91 L3MBTL1 (0.43) MAPTALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL17070001 0.90 L3MBTL1 (0.44) MAPTALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL19795438 0.90 L3MBTL1 (0.44) MAPTALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL25373230 0.90 L3MBTL1 (0.44) MAPTALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL17540464 0.87 KMT2A (0.50) MAPTALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL17545816 0.85 SMN1; SMN2 (0.38) MAPTALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL17545815 0.84 KMT2A (0.37) MAPTALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL19795424 0.84 L3MBTL1 (0.40) MAPTALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL17540459 0.82 KMT2A (0.39) MAPTALDH1A1KMT2AMEN1SMN1; SMN2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9383480-B2 Photocurable acrylate composition CHANGZHOU TRONLY ADVANCED ELECTRONIC MATERIALS CO., LTD. (CN) 2016-07-05 US disclosed
US-9383480-B2 Photocurable acrylate composition CHANGZHOU TRONLY ADVANCED ELECTRONIC MATERIALS CO., LTD. (CN) 2016-07-05 US disclosed
EP-3002632-A1 ACRYLIC PHOTOCURABLE COMPOSITION Changzhou Tronly Advanced Electronics Materials Co., Ltd. (CN) 2016-04-06 EP disclosed
US-20160047945-A1 PHOTOCURABLE ACRYLATE COMPOSITION CHANGZHOU TRONLY ADVANCED ELECTRONIC MATERIALS CO., LTD. (CN) 2016-02-18 US disclosed
US-20160047945-A1 PHOTOCURABLE ACRYLATE COMPOSITION CHANGZHOU TRONLY ADVANCED ELECTRONIC MATERIALS CO., LTD. (CN) 2016-02-18 US disclosed